2-azanyl-6-methylsulfanyl-4-propan-2-yl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-methylsulfanyl-4-propan-2-yl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-isopropyl-6-methylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-(methylthio)-4-propan-2-ylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-methylsulfanyl-4-propan-2-ylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-4-isopropyl-6-(methylthio)pyridin-1-ium-3,5-dicarbonitrile Formula: C11H13N4S+ MolecularWeight: 233.31272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=[NH+]C(=C1C#N)SC)N)C#N

Isomeric SMILES

CC(C)C1=C(C(=[NH+]C(=C1C#N)SC)N)C#N

InChI

InChI=1S/C11H12N4S/c1-6(2)9-7(4-12)10(14)15-11(16-3)8(9)5-13/h6H,1-3H3,(H2,14,15)/p+1